COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL529325
Chemical Name: 4-hydroxy-1-(3-methylphenyl)-6-oxo-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-2-ium-1-yl)-1,6-dihydropyrimidine-2-thiolate
Smiles: Cc1cccc(c1)n1c([S-])nc(c(c1=O)C1[NH2+]CCc2c1[nH]c1c2cccc1)O

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Molecular Weight: 404.49
Empirical Formula: C22H20N4O2S

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 4.441
Rotatable bonds: 2
H-donors: 4
H-acceptors: 2
PSA: 85
Number of rings: 5

     

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